Attributes
UniProt ID
Protein Name
3-hydroxy-3-methylglutaryl-coenzyme A reductase
Ligand Name
(3R,5R)-7-{2-[(4-fluorobenzyl)carbamoyl]-4-(4-fluorophenyl)-1-(1-methylethyl)-1H-imidazol-5-yl}-3,5-dihydroxyheptanoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KNKKPGAQSAHIHV-FGZHOGPDSA-N
SMILES
CC(C)n1c(c(nc1C(=O)NCc2ccc(cc2)F)c3ccc(cc3)F)CCC(CC(CC(=O)O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3CD0
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Color Legend
Unassigned regionsLigand / hetero atomse3cd0A1e3cd0A2e3cd0B1e3cd0B2e3cd0C1e3cd0C2e3cd0D1e3cd0D2
ECOD domains from experimental PDB structures interacting with ligand 6HI
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P04035 | n/a | 6HI | 3cd0 | e3cd0A1 | A:570-686 |
| P04035 | n/a | 6HI | 3cd0 | e3cd0A2 | A:441-569,A:687-861 |
| P04035 | n/a | 6HI | 3cd0 | e3cd0B2 | B:441-569,B:687-861 |
| P04035 | n/a | 6HI | 3cd0 | e3cd0C1 | C:579-695 |
| P04035 | n/a | 6HI | 3cd0 | e3cd0C2 | C:444-578,C:696-860 |
| P04035 | n/a | 6HI | 3cd0 | e3cd0D1 | D:576-692 |
| P04035 | n/a | 6HI | 3cd0 | e3cd0D2 | D:458-575,D:693-861 |